# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-27T11:38:04+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Journal of Solid State Chemistry') AND volume = 236 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1561562","10.7337","0.0014","6.2506","0.0003","12.8869","0.0014","90","","106.07","0.004","90","","830.82","0.15","","","300","","","","100","","","","","3","C 1 c 1","C -2yc","9","","","","- Cu2.06 O11 Ta4 -","- Cu2.05 O11 Ta4 -","- Cu8.2 O44 Ta16 -","4","1","","King, Nacole; Sullivan, Ian; Watkins-Curry, Pilanda; Chan, Julia Y.; Maggard, Paul A.","Flux-mediated syntheses, structural characterization and low-temperature polymorphism of the p-type semiconductor Cu2Ta4O11","Journal of Solid State Chemistry","2016","236","","10","18","10.1016/j.jssc.2015.08.041","powder diffraction","x-ray","1.5406","Kα~1,2~","","","","","","0.08587","","0.09653","","2.517","","","","","","","has coordinates","263977","2021-04-08","08:30:13",""
"1561563","5.734","0.0008","5.734","0.0008","7.3859","0.0015","90","","90","","120","","210.3","0.06","293","2","293","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- Ba K2 Mn O8 V2 -","- Ba K2 Mn O8 V2 -","- Ba K2 Mn O8 V2 -","1","0.0833333","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0225","0.0224","","","0.0541","0.0542","","","","","","1.124","","","","has coordinates","263978","2021-04-08","08:40:14",""
"1561564","5.2887","0.0007","5.2887","0.0007","7.3026","0.0015","90","","90","","120","","176.89","0.05","293","2","293","2","","","","","","","","5","P -3","-P 3","147","","","","- Ba Li2 Mn O8 V2 -","- Ba Li2 Mn O8 V2 -","- Ba Li2 Mn O8 V2 -","1","0.166667","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0207","0.0207","","","0.055","0.0551","","","","","","1.19","","","","has coordinates","263978","2021-04-08","08:40:14",""
"1561565","5.5489","0.0008","5.5489","0.0008","7.0741","0.0014","90","","90","","120","","188.63","0.05","293","2","293","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- Ba Co Na2 O8 V2 -","- Ba Co Na2 O8 V2 -","- Ba Co Na2 O8 V2 -","1","0.0833333","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0265","0.0265","","","0.0631","0.0631","","","","","","1.125","","","","has coordinates","263978","2021-04-08","08:40:15",""
"1561566","5.5731","0.0008","5.5731","0.0008","7.1034","0.0014","90","","90","","120","","191.07","0.05","293","2","293","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- Ba Fe Na2 O8 V2 -","- Ba Fe Na2 O8 V2 -","- Ba Fe Na2 O8 V2 -","1","0.0833333","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0322","0.0322","","","0.0766","0.0766","","","","","","1.194","","","","has coordinates","263978","2021-04-08","08:40:15",""
"1561567","5.5921","0.0008","5.5921","0.0008","7.1628","0.0014","90","","90","","120","","193.98","0.05","293","2","293","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- Ba Mn Na2 O8 V2 -","- Ba Mn Na2 O8 V2 -","- Ba Mn Na2 O8 V2 -","1","0.0833333","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0258","0.0258","","","0.0766","0.0766","","","","","","1.184","","","","has coordinates","263978","2021-04-08","08:40:15",""
"1561568","13.677","0.003","5.5025","0.0011","9.5767","0.0019","90","","90.01","0.03","90","","720.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Co Na2 O8 Sr V2 -","- Co Na2 O8 Sr V2 -","- Co4 Na8 O32 Sr4 V8 -","4","1","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0609","0.0509","","","0.1173","0.1283","","","","","","1.196","","","","has coordinates","263978","2021-04-08","08:40:15",""
"1561569","13.823","0.003","5.5671","0.0011","9.6686","0.0019","90","","90.09","0.03","90","","744","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Mn Na2 O8 Sr V2 -","- Mn Na2 O8 Sr V2 -","- Mn4 Na8 O32 Sr4 V8 -","4","1","","Sanjeewa, Liurukara D.; McMillen, Colin D.; Willett, Daniel; Chumanov, George; Kolis, Joseph W.","Hydrothermal synthesis of single crystals of transition metal vanadates in the glaserite phase","Journal of Solid State Chemistry","2016","236","","61","68","10.1016/j.jssc.2015.07.039","","","0.71073","MoKα","","0.0249","0.023","","","0.0555","0.0572","","","","","","1.118","","","","has coordinates","263978","2021-04-08","08:40:15",""
"1561570","9.8594","0.0003","9.8594","0.0003","13.0211","0.0008","90","","90","","120","","1096.17","0.08","100","2","100","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- F30 Mg1.43 Na3.13 U6 -","- F30 Mg1.4342 Na3.1298 U6 -","- F60 Mg2.8684 Na6.2596 U12 -","2","0.166667","","Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; zur Loye, Hans-Conrad","Mild hydrothermal crystal growth of new uranium(IV) fluorides, Na3.13Mg1.43U6F30 and Na2.50Mn1.75U6F30: Structures, optical and magnetic properties","Journal of Solid State Chemistry","2016","236","","83","88","10.1016/j.jssc.2015.04.036","","","0.71073","MoKα","","0.0281","0.0256","","","0.0535","0.0542","","","","","","1.19","","","","has coordinates","263979","2021-04-08","08:44:38",""
"1561571","9.8578","0.0003","9.8578","0.0003","13.192","0.0008","90","","90","","120","","1110.2","0.08","100","2","100","2","","","","","","","","4","P -3 c 1","-P 3 2""c","165","","","","- F30 Mn1.75 Na2.5 U6 -","- F30 Mn1.746 Na2.5042 U6 -","- F60 Mn3.492 Na5.0084 U12 -","2","0.166667","","Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; zur Loye, Hans-Conrad","Mild hydrothermal crystal growth of new uranium(IV) fluorides, Na3.13Mg1.43U6F30 and Na2.50Mn1.75U6F30: Structures, optical and magnetic properties","Journal of Solid State Chemistry","2016","236","","83","88","10.1016/j.jssc.2015.04.036","","","0.71073","MoKα","","0.0362","0.0307","","","0.0687","0.0703","","","","","","1.19","","","","has coordinates","263979","2021-04-08","08:44:39",""
"1561572","9.5292","0.0002","9.5292","0.0002","9.5292","0.0002","90","","90","","90","","865.31","0.03","296","2","296","2","","","","","","","","3","I m -3 m","-I 4 2 3","229","","","","- Fe0.36 Mo2.64 Sb7 -","- Fe0.363 Mo2.637 Sb7 -","- Fe1.452 Mo10.548 Sb28 -","4","0.0416667","","Guo, Quansheng; Assoud, Abdeljalil; Kleinke, Holger","Different site occupancies in substitution variants of Mo3Sb7","Journal of Solid State Chemistry","2016","236","","123","129","10.1016/j.jssc.2015.08.017","","","0.71073","MoKα","","0.0174","0.0151","","","0.0412","0.0423","","","","","","1.125","","","","has coordinates","263980","2021-04-08","09:03:42",""
"1561573","9.5653","0.0004","9.5653","0.0004","9.5653","0.0004","90","","90","","90","","875.18","0.06","293","2","296","2","","","","","","","","3","I m -3 m","-I 4 2 3","229","","","","- Mo2.85 Ni0.21 Sb7 -","- Mo2.85 Ni0.21 Sb7 -","- Mo11.4 Ni0.84 Sb28 -","4","0.0416667","","Guo, Quansheng; Assoud, Abdeljalil; Kleinke, Holger","Different site occupancies in substitution variants of Mo3Sb7","Journal of Solid State Chemistry","2016","236","","123","129","10.1016/j.jssc.2015.08.017","","","0.71073","MoKα","","0.0178","0.0176","","","0.0402","0.0405","","","","","","1.571","","","","has coordinates","263980","2021-04-08","09:03:51",""
"1561574","13.0114","0.001","13.0114","0.001","9.0552","0.001","90","","90","","120","","1327.6","0.2","293","2","293","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","Gd2 Ru3 Al15.09","","","- Al15.09 Gd2 Ru3 -","- Al15.0861 Gd2 Ru3 -","- Al60.3444 Gd8 Ru12 -","4","0.166667","","Morrison, Gregory; Prestigiacomo, Joseph; Haldolaarachchige, Neel; Rai, Binod K.; Young, David P.; Stadler, Shane; Morosan, Emilia; Chan, Julia Y.","Synthesis and anisotropic properties of single crystalline Ln2Ru3Al15+ (Ln=Gd, Tb)","Journal of Solid State Chemistry","2016","236","","186","194","10.1016/j.jssc.2015.08.009","","","0.71073","MoKα","","0.0265","0.0229","","","0.0512","0.0528","","","","","","1.128","","","","has coordinates","263981","2021-04-08","09:11:16",""
"1561575","13.0072","0.001","13.0072","0.001","9.0289","0.001","90","","90","","120","","1322.9","0.2","293","2","293","2","","","","","","","","3","P 63/m c m","-P 6c 2","193","Tb2 Ru3 Al15.05","","","- Al15.05 Ru3 Tb2 -","- Al15.0467 Ru3 Tb2 -","- Al60.187 Ru12 Tb8 -","4","0.166667","","Morrison, Gregory; Prestigiacomo, Joseph; Haldolaarachchige, Neel; Rai, Binod K.; Young, David P.; Stadler, Shane; Morosan, Emilia; Chan, Julia Y.","Synthesis and anisotropic properties of single crystalline Ln2Ru3Al15+ (Ln=Gd, Tb)","Journal of Solid State Chemistry","2016","236","","186","194","10.1016/j.jssc.2015.08.009","","","0.71073","MoKα","","0.0276","0.0229","","","0.0528","0.0548","","","","","","1.154","","","","has coordinates","263981","2021-04-08","09:11:17",""
"1561576","12.0163","0.0001","12.0163","0.0001","16.5396","0.0002","90","","90","","90","","2388.18","0.04","296","2","296","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ce11 Ge3.73 In6.27 -","- Ce11 Ge3.731 In6.269 -","- Ce44 Ge14.924 In25.076 -","4","0.125","","Jeon, Beom-Yong; Nam, Gnu; Lee, Dong Woo; Min Ok, Kang; You, Tae-Soo","Ce11Ge3.73(2)In6.27: Solid-state synthesis, crystal structure and site-preference","Journal of Solid State Chemistry","2016","236","","195","202","10.1016/j.jssc.2015.07.049","","","0.71073","MoKα","","0.0224","0.0203","","","0.0367","0.0371","","","","","","1.28","","","","has coordinates","263982","2021-04-08","09:35:03",""
"1561577","8.548","0.003","9.168","0.003","12.58","0.005","89.467","0.01","72.849","0.01","65.478","0.014","849.8","0.5","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H19 N2 O11 P3 V2 -","- C6 H19 N2 O11 P3 V2 -","- C12 H38 N4 O22 P6 V4 -","2","1","","Nourmahnad, Anahita; Wenny, Malia B.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.","The role of inorganic acidity on templated vanadate composition and dimensionality","Journal of Solid State Chemistry","2016","236","","215","221","10.1016/j.jssc.2015.08.007","","","0.71073","MoKα","","0.0284","0.0272","","0.0715","0.071","0.0702","","","","","","1.0067","","","","has coordinates","263983","2021-04-08","09:39:02",""
"1561578","7.7302","0.0015","11.269","0.002","6.8439","0.0014","90","","107.9","0.03","90","","567.3","0.2","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","NH4CoCl2(HCOO)","NH4CoCl2(HCOO)","","- C H5 Cl2 Co N O2 -","- C H5 Cl2 Co N O2 -","- C4 H20 Cl8 Co4 N4 O8 -","4","0.5","","Greenfield, Joshua T.; Ovidiu Garlea, V.; Kamali, Saeed; Chen, Michael; Kovnir, Kirill","Synthesis, crystal growth, structural and magnetic characterization of NH4MCl2(HCOO), M=(Fe, Co, Ni)","Journal of Solid State Chemistry","2016","236","","222","229","10.1016/j.jssc.2015.09.016","","","0.71073","MoKα","","0.0159","0.0139","","","0.0326","0.0335","","","","","","1.104","","","","has coordinates","263984","2021-04-08","09:43:30",""
"1561579","7.598","0.0015","11.336","0.002","6.753","0.0014","90","","107.68","0.03","90","","554.2","0.2","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","NH4NiCl2(HCOO)","NH4NiCl2(HCOO)","","- C H5 Cl2 N Ni O2 -","- C H5 Cl2 N Ni O2 -","- C4 H20 Cl8 N4 Ni4 O8 -","4","0.5","","Greenfield, Joshua T.; Ovidiu Garlea, V.; Kamali, Saeed; Chen, Michael; Kovnir, Kirill","Synthesis, crystal growth, structural and magnetic characterization of NH4MCl2(HCOO), M=(Fe, Co, Ni)","Journal of Solid State Chemistry","2016","236","","222","229","10.1016/j.jssc.2015.09.016","","","0.71073","MoKα","","0.0171","0.0157","","","0.0386","0.0394","","","","","","1.112","","","","has coordinates","263984","2021-04-08","09:43:31",""
"1561580","105.224","0.004","12.2441","0.0005","17.0143","0.0006","90","","89.9905","0.0013","90","","21920.8","1.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13.5 H6.75 Al O7.75 -","- C13.5 H6.75 Al O7.75 -","- C864 H432 Al64 O496 -","64","16","","Wang, Xiqu; Jacobson, Allan J.","Hydrothermal crystal growth and Vernier structures of the metal benzenedicarboxylates MIL-47 and MIL-53 containing guest molecules of benzenecarboxylic acid","Journal of Solid State Chemistry","2016","236","","230","235","10.1016/j.jssc.2015.08.014","","","1.54178","CuKα","","0.2643","0.1583","","","0.374","0.406","","","","","","0.993","","","","has coordinates,has disorder","263985","2021-04-08","09:54:21",""
"1561581","114.562","0.005","12.1503","0.0005","17.4275","0.0007","90","","89.999","0.001","90","","24258.4","1.8","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13.65 H8.24 Ga O7.82 -","- C13.6471 H6.82353 Ga O7.82353 -","- C928 H464 Ga68 O532 -","68","34","","Wang, Xiqu; Jacobson, Allan J.","Hydrothermal crystal growth and Vernier structures of the metal benzenedicarboxylates MIL-47 and MIL-53 containing guest molecules of benzenecarboxylic acid","Journal of Solid State Chemistry","2016","236","","230","235","10.1016/j.jssc.2015.08.014","","","1.54178","CuKα","","0.2135","0.1473","","","0.3661","0.3981","","","","","","1.006","","","","has coordinates","263985","2021-04-08","09:54:24",""
"1561582","23.903","0.002","17.1907","0.0015","25.722","0.002","90","","105.914","0.0008","90","","10164.3","1.5","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13.71 H6.86 O7.86 V -","- C13.7143 H6.85714 O7.85714 V -","- C384 H192 O220 V28 -","28","14","","Wang, Xiqu; Jacobson, Allan J.","Hydrothermal crystal growth and Vernier structures of the metal benzenedicarboxylates MIL-47 and MIL-53 containing guest molecules of benzenecarboxylic acid","Journal of Solid State Chemistry","2016","236","","230","235","10.1016/j.jssc.2015.08.014","","","0.71073","MoKα","","0.1481","0.0361","","","0.0788","0.0964","","","","","","0.96","","","","has coordinates","263985","2021-04-08","09:54:24",""